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3-allyl-2-((2-methylallyl)thio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
SpectraBase Compound ID 5VOrYsmQCdw
InChI InChI=1S/C24H28N2OS/c1-4-14-26-22(27)20-21(25-23(26)28-16-17(2)3)19-11-7-6-10-18(19)15-24(20)12-8-5-9-13-24/h4,6-7,10-11H,1-2,5,8-9,12-16H2,3H3
InChIKey CMTMFCQMZRULOU-UHFFFAOYSA-N
Mol Weight 392.56 g/mol
Molecular Formula C24H28N2OS
Exact Mass 392.192235 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1aX6FCFGfJN
Name 3-allyl-2-((2-methylallyl)thio)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C24H28N2OS/c1-4-14-26-22(27)20-21(25-23(26)28-16-17(2)3)19-11-7-6-10-18(19)15-24(20)12-8-5-9-13-24/h4,6-7,10-11H,1-2,5,8-9,12-16H2,3H3
InChIKey CMTMFCQMZRULOU-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_3490
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: 112209; Labnumber: AMIR-4538; VK_ID: VK-003491
Temperature 308 °C